(1S,2R)-2-[(1S)-1-azanyl-2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxidanylidene-ethyl]-N-ethyl-cyclopropane-1-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: (1S,2R)-2-[(1S)-1-azanyl-2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxidanylidene-ethyl]-N-ethyl-cyclopropane-1-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: (1S,2R)-2-[(1S)-1-amino-2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxo-ethyl]-N-ethyl-cyclopropanecarboxamide; 2,2,2-trifluoroacetic acid CAS Name: (1S,2R)-2-[(1S)-1-amino-2-[(2S)-2-cyano-1-pyrrolidinyl]-2-oxoethyl]-N-ethyl-1-cyclopropanecarboxamide; 2,2,2-trifluoroacetic acid IUPAC Name: (1S,2R)-2-[(1S)-1-amino-2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]-N-ethylcyclopropane-1-carboxamide; 2,2,2-trifluoroacetic acid Traditional Name: (1S,2R)-2-[(1S)-1-amino-2-[(2S)-2-cyanopyrrolidino]-2-keto-ethyl]-N-ethyl-cyclopropanecarboxamide; 2,2,2-trifluoroacetic acid Formula: C15H21F3N4O4 MolecularWeight: 378.34685

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1CC1C(C(=O)N2CCCC2C#N)N.C(=O)(C(F)(F)F)O

Isomeric SMILES

CCNC(=O)[C@H]1C[C@H]1[C@@H](C(=O)N2CCC[C@H]2C#N)N.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C13H20N4O2.C2HF3O2/c1-2-16-12(18)10-6-9(10)11(15)13(19)17-5-3-4-8(17)7-14;3-2(4,5)1(6)7/h8-11H,2-6,15H2,1H3,(H,16,18);(H,6,7)/t8-,9+,10-,11-;/m0./s1